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Ligand

NameCHEMBL3342953
Molecular formulaC31H32N2O8
IUPAC name4-(4-carboxybutanoyl)-8-[[4-(4-phenylbutoxy)benzoyl]amino]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid
Molecular weight560.603
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.9
SynonymsBDBM50033083
SCHEMBL3095629
Inchi KeyWJAVSSKFTCSRBJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H32N2O8/c34-27(13-7-14-28(35)36)33-20-26(31(38)39)41-29-24(11-6-12-25(29)33)32-30(37)22-15-17-23(18-16-22)40-19-5-4-10-21-8-2-1-3-9-21/h1-3,6,8-9,11-12,15-18,26H,4-5,7,10,13-14,19-20H2,(H,32,37)(H,35,36)(H,38,39)
PubChem CID23124672
ChEMBLCHEMBL3342953
IUPHARN/A
BindingDB50033083
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
456593Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
456592Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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